2-[[3-(butanoylamino)-2-tridecoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[3-(butanoylamino)-2-tridecoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[3-(butanoylamino)-2-tridecoxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[3-(1-oxobutylamino)-2-tridecoxypropoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[3-(butanoylamino)-2-tridecoxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[(3-butyramido-2-tridecoxy-propoxy)-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C25H54N2O6P+ MolecularWeight: 509.679821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(CNC(=O)CCC)COP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCOC(CNC(=O)CCC)COP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C25H53N2O6P/c1-6-8-9-10-11-12-13-14-15-16-17-20-31-24(22-26-25(28)18-7-2)23-33-34(29,30)32-21-19-27(3,4)5/h24H,6-23H2,1-5H3,(H-,26,28,29,30)/p+1